In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2008 | 32 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.91 | 5.4 | -59.63 | 2 | 9 | 1 | 114 | 482.604 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 1.98 | -24.86 | 1 | 9 | 0 | 113 | 481.596 | 9 | ↓ |